Compound Detail
CHEMBL435802
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Basic Information
| ChEMBL ID | CHEMBL435802 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OGFDKGAXVKUJBQ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
205.2
MW (Da)
0.37
ALogP
4
HBA
4
HBD
86.7
PSA (Ų)
0.53
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adrenergic receptor alpha-2 CHEMBL2093864 | Ki | 6.12 | 6.12 | 750.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adrenergic receptor alpha-2 | Ki | = | 750.0 | nM | 6.12 | Displacement of [3H]clonidine from adrenergic alpha 2 receptor of rat cerebral c... | 8254623 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8254623 | 10.1021/jm00076a024 | Adrenergic receptor alpha-2 | 1 |
| 8254623 | 10.1021/jm00076a024 | Beta-1 adrenergic receptor | 1 |
| 8254623 | 10.1021/jm00076a024 | Cavia porcellus | 1 |
| 8254623 | 10.1021/jm00076a024 | Adrenergic receptor beta | 1 |
Data from ChEMBL 36 via Core Engine